3-[3-butyl-2,6-bis(oxidanylidene)-7-pentyl-purin-8-yl]-N-cyclohexyl-propanamide

Systemtic Name: 3-[3-butyl-2,6-bis(oxidanylidene)-7-pentyl-purin-8-yl]-N-cyclohexyl-propanamide Openeye Name: 3-(3-butyl-2,6-dioxo-7-pentyl-purin-8-yl)-N-cyclohexyl-propanamide CAS Name: 3-(3-butyl-2,6-dioxo-7-pentyl-8-purinyl)-N-cyclohexylpropanamide IUPAC Name: 3-(3-butyl-2,6-dioxo-7-pentylpurin-8-yl)-N-cyclohexylpropanamide Traditional Name: 3-(7-amyl-3-butyl-2,6-diketo-purin-8-yl)-N-cyclohexyl-propionamide Formula: C23H37N5O3 MolecularWeight: 431.57158

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=NC2=C1C(=O)NC(=O)N2CCCC)CCC(=O)NC3CCCCC3

Isomeric SMILES

CCCCCN1C(=NC2=C1C(=O)NC(=O)N2CCCC)CCC(=O)NC3CCCCC3

InChI

InChI=1S/C23H37N5O3/c1-3-5-10-16-27-18(13-14-19(29)24-17-11-8-7-9-12-17)25-21-20(27)22(30)26-23(31)28(21)15-6-4-2/h17H,3-16H2,1-2H3,(H,24,29)(H,26,30,31)